Vitas-M small molecule compound
3-(3-chlorophenyl)-2-{[2-(2-hydroxyethoxy)ethyl]amino}-3,5,6,7,8,9-hexahydro-4H-cyclohepta[4,5]thieno[2,3-d]pyrimidin-4-one
Catalog ID
STK581871
SMILES OCCOCCNc1nc2sc3c(c2c(=O)n1c1cccc(c1)Cl)CCCCC3
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C21H24ClN3O3S MW 433.96 g/mol Purity >90% as per NMR
InChI
InChI=1S/C21H24ClN3O3S/c22-14-5-4-6-15(13-14)25-20(27)18-16-7-2-1-3-8-17(16)29-19(18)24-21(25)23-9-11-28-12-10-26/h4-6,13,26H,1-3,7-12H2,(H,23,24)InChIKey
OPWJNRJMTIPQLS-UHFFFAOYSA-NSynonyms
896594-75-53(3chlorophenyl)2((2(2hydroxyethoxy)ethyl)amino)356789hexahydro4Hcyclohepta(45)thieno(23d)pyrimidin4one
3(3chlorophenyl)2((2(2hydroxyethoxy)ethyl)amino)6789tetrahydro3Hcyclohepta(45)thieno(23d)pyrimidin4(5H)one
3(3chlorophenyl)2(2(2hydroxyethoxy)ethylamino)6789tetrahydro5Hcyclohepta(23)thieno(24b)pyrimidin4one
896594755
C1CCC2=C(CC1)SC3=C2C(=O)N(C(=N3)NCCOCCO)C4=CC(=CC=C4)Cl
InChI=1SC21H24ClN3O3Sc221454615(1314)2520(27)18167213817(16)2919(18)2421(25)2391128121026h461326H13712H2(H2324)
MFCD06593478
ZINC000002442656
ZINC02442656
ZINC2442656
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